Basic information
- CAS
71712-33-9- Standard SMILES
C=CC(c1ccccc1)c1cc2c(cc1OC)OCO2- InChIKey
RZMZDKJSCCQYNY-UHFFFAOYSA-N- Molecular formula
- C17H16O3
- Average molar mass
- 268.31 g/mol
- Monoisotopic mass
- 268.10994437
Names & identifiers
- Preferred name
- 5-Methoxy-6-(1-phenylprop-2-en-1-yl)-2H-1,3-benzodioxole
- IUPAC
- 5-methoxy-6-(1-phenylprop-2-enyl)-1,3-benzodioxole
Names & synonyms
71712-33-9NSC350132SCHEMBL11089475DTXSID203197675-Methoxy-6-(1-phenylprop-2-en-1-yl)-2H-1,3-benzodioxoleNSC-350132
Database identifiers
- CAS
71712-33-9- PubChem CID
- 336366
- DTXSID
DTXSID20319767
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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